| SpectraBase Compound ID | 4FnpiK3WSSj |
|---|---|
| InChI | InChI=1S/C19H18ClN3/c20-15-8-9-17-16(10-15)19(14-4-2-1-3-5-14)22-12-18(23-17)21-11-13-6-7-13/h1-5,8-10,13H,6-7,11-12H2,(H,21,23) |
| InChIKey | VTWBVDZYTPERDH-UHFFFAOYSA-N |
| Mol Weight | 323.83 g/mol |
| Molecular Formula | C19H18ClN3 |
| Exact Mass | 323.118925 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7diucImenGX |
|---|---|
| Name | Cyprazepam artifact (deoxo-) P1049 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.118925292 u |
| Formula | C19H18ClN3 |
| InChI | InChI=1S/C19H18ClN3/c20-15-8-9-17-16(10-15)19(14-4-2-1-3-5-14)22-12-18(23-17)21-11-13-6-7-13/h1-5,8-10,13H,6-7,11-12H2,(H,21,23) |
| InChIKey | VTWBVDZYTPERDH-UHFFFAOYSA-N |
| Molecular Weight | 323.827 g/mol |
| SMILES | C1=C(C=C2C(N=C(NCC3CC3)CN=C2C2=CC=CC=C2)=C1)Cl |